200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 16892-50-5
16892-50-5 | 8-thiabicyclo[3.2.1]octan-3-one
CAS No: 16892-50-5 Catalog No: AG001YEL MDL No:MFCD24688193
Product Description
Catalog Number:
AG001YEL
Chemical Name:
8-thiabicyclo[3.2.1]octan-3-one
CAS Number:
16892-50-5
Molecular Formula:
C7H10OS
Molecular Weight:
142.2187
MDL Number:
MFCD24688193
IUPAC Name:
8-thiabicyclo[3.2.1]octan-3-one
InChI:
InChI=1S/C7H10OS/c8-5-3-6-1-2-7(4-5)9-6/h6-7H,1-4H2
InChI Key:
WRKYCQOFEBORNV-UHFFFAOYSA-N
SMILES:
O=C1CC2CCC(C1)S2
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.045g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.216g/mol
Monoisotopic Mass:
142.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.